2-benzamido-N-prop-2-enylbenzamide

C17H16N2O2 — CID 2194118

IUPAC2-benzamido-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C17H16N2O2/c1-2-12-18-17(21)14-10-6-7-11-15(14)19-16(20)13-8-4-3-5-9-13/h2-11H,1,12H2,(H,18,21)(H,19,20)
InChIKeyAQMJKODHLTZTGP-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.85
Rot. Bonds5

About 2-benzamido-N-prop-2-enylbenzamide

2-benzamido-N-prop-2-enylbenzamide (PubChem CID 2194118) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-benzamido-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-benzamido-N-prop-2-enylbenzamide
PubChem CID2194118
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name2-benzamido-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C17H16N2O2/c1-2-12-18-17(21)14-10-6-7-11-15(14)19-16(20)13-8-4-3-5-9-13/h2-11H,1,12H2,(H,18,21)(H,19,20)
InChIKeyAQMJKODHLTZTGP-UHFFFAOYSA-N
XLogP2.85
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-prop-2-enylbenzamide?
The IUPAC name of 2-benzamido-N-prop-2-enylbenzamide (CID 2194118) is 2-benzamido-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-benzamido-N-prop-2-enylbenzamide?
The canonical SMILES for 2-benzamido-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccccc1NC(=O)c1ccccc1.
What is the InChIKey of 2-benzamido-N-prop-2-enylbenzamide?
The InChIKey is AQMJKODHLTZTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-2-12-18-17(21)14-10-6-7-11-15(14)19-16(20)13-8-4-3-5-9-13/h2-11H,1,12H2,(H,18,21)(H,19,20).
What are the key properties of 2-benzamido-N-prop-2-enylbenzamide?
2-benzamido-N-prop-2-enylbenzamide has a molecular weight of 280.33 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-prop-2-enylbenzamide is sourced from PubChem (CID 2194118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).